#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6z s SER 2 N 0.00 -0.09 0.87 1.61 0.01 -1.26 -5.17 113.70 109.66 2k6z s SER 2 Ca 0.00 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.76 2k6z s SER 2 Cb 0.00 0.40 0.11 0.00 0.21 0.00 0.00 66.02 66.74 2k6z s SER 2 CO 0.00 -0.75 1.09 0.72 0.41 0.00 0.00 173.24 174.72 2k6z s PHE 3 N -3.46 2.45 -0.30 2.43 -0.12 -1.26 -5.09 117.98 112.64 2k6z s PHE 3 Ca 0.01 1.24 -0.04 0.00 -0.05 0.00 0.00 56.93 58.09 2k6z s PHE 3 Cb 0.02 -3.15 0.19 0.00 -0.63 0.00 0.00 43.02 39.45 2k6z s PHE 3 CO -0.09 -2.22 0.84 0.99 -0.05 0.00 0.00 175.22 174.68 2k6z s THR 4 N -2.99 -0.61 0.41 -4.49 2.01 -1.26 -5.19 115.64 103.53 2k6z s THR 4 Ca 0.63 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.64 2k6z s THR 4 Cb -0.17 -0.68 -0.00 0.00 0.01 0.00 0.00 72.50 71.65 2k6z s THR 4 CO 0.56 0.00 0.05 -0.62 -0.69 0.00 0.00 174.62 173.92 2k6z n GLU 5 N 5.29 0.82 -2.59 4.92 4.71 -1.26 -4.64 120.64 127.90 2k6z n GLU 5 Ca 0.05 -3.15 -0.23 0.00 -0.01 0.00 0.00 57.16 53.82 2k6z n GLU 5 Cb 0.55 1.14 0.10 0.00 -1.01 0.00 0.00 31.44 32.22 2k6z n GLU 5 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2k6z s GLY 6 N -3.34 1.76 -0.02 0.62 0.00 -1.26 -4.78 107.32 100.29 2k6z s GLY 6 Ca 0.06 -1.71 -0.16 0.00 0.00 0.00 0.00 44.72 42.91 2k6z s GLY 6 CO 0.05 -1.16 0.34 0.66 0.00 0.00 0.00 173.10 172.98 2k6z s TRP 7 N -3.12 -0.22 0.16 1.90 -2.14 -0.04 -4.06 118.94 111.42 2k6z s TRP 7 Ca 0.66 0.36 -0.08 0.00 2.66 0.00 0.00 56.10 59.69 2k6z s TRP 7 Cb -0.06 0.12 -0.06 0.00 -3.10 0.00 0.00 33.47 30.37 2k6z s TRP 7 CO 0.44 -0.39 0.45 0.08 -2.66 0.00 0.00 176.95 174.87 2k6z s VAL 8 N -1.24 5.05 0.00 -0.66 1.01 0.22 -1.36 120.40 123.42 2k6z s VAL 8 Ca -0.13 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2k6z s VAL 8 Cb -0.05 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2k6z s VAL 8 CO 0.04 0.07 0.00 -1.14 0.00 0.00 0.00 175.10 174.07 2k6z n ARG 9 N 0.23 3.47 -3.66 2.72 0.00 -0.66 -1.19 116.66 117.57 2k6z n ARG 9 Ca -0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 57.85 57.74 2k6z n ARG 9 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.89 2k6z n ARG 9 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 2k6z s PHE 10 N 0.00 -0.82 -0.16 -0.14 5.36 -1.24 -4.02 117.98 116.95 2k6z s PHE 10 Ca 0.00 1.57 -0.29 0.00 -0.96 0.00 0.00 56.93 57.25 2k6z s PHE 10 Cb 0.00 0.34 0.10 0.00 -0.34 0.00 0.00 43.02 43.12 2k6z s PHE 10 CO 0.00 -0.48 0.88 -1.12 -1.46 0.00 0.00 175.22 173.04 2k6z s SER 11 N 2.50 -0.51 0.17 6.13 0.01 -1.26 -4.97 113.70 115.77 2k6z s SER 11 Ca -0.03 0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.93 2k6z s SER 11 Cb -0.12 0.61 0.04 0.00 0.21 0.00 0.00 66.02 66.77 2k6z s SER 11 CO -0.13 -0.37 1.41 1.55 0.41 0.00 0.00 173.24 176.11 2k6z h PRO 12 N 3.27 0.32 0.00 12.44 0.13 -1.86 -1.25 132.00 145.05 2k6z h PRO 12 Ca -0.24 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2k6z h PRO 12 Cb 1.16 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2k6z h PRO 12 CO 0.27 0.96 0.00 0.41 -0.23 0.00 0.00 178.00 179.40 2k6z n GLY 13 N 0.68 0.88 0.00 1.56 0.00 -1.26 -4.30 105.19 102.75 2k6z n GLY 13 Ca -0.04 -1.57 0.14 0.00 0.00 0.00 0.00 46.02 44.55 2k6z n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k6z n PRO 14 N -1.50 0.49 -4.17 1.61 -0.04 -1.26 -4.99 135.00 125.14 2k6z n PRO 14 Ca 0.00 0.02 -0.10 0.00 -0.04 0.00 0.00 63.50 63.38 2k6z n PRO 14 Cb 0.00 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2k6z n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6z s ASN 15 N -2.46 0.64 0.27 3.54 2.20 -1.26 -1.02 114.94 116.85 2k6z s ASN 15 Ca 0.29 -1.16 0.05 0.00 -0.94 0.00 0.00 52.86 51.11 2k6z s ASN 15 Cb 0.19 0.22 -0.02 0.00 -2.00 0.00 0.00 41.25 39.64 2k6z s ASN 15 CO 0.41 -0.65 0.20 0.00 -2.94 0.00 0.00 177.10 174.11 2k6z n ALA 16 N -0.11 0.53 -2.61 3.54 0.00 0.07 -4.72 120.51 117.22 2k6z n ALA 16 Ca -0.07 -1.52 -0.14 0.00 0.00 0.00 0.00 53.44 51.71 2k6z n ALA 16 Cb 0.63 1.19 -0.11 0.00 0.00 0.00 0.00 19.45 21.16 2k6z n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k6z s ALA 17 N -3.01 0.88 0.03 0.00 0.00 -1.26 -0.50 121.76 117.90 2k6z s ALA 17 Ca 0.28 -1.02 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 2k6z s ALA 17 Cb 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 2k6z s ALA 17 CO 0.20 -0.04 0.08 0.00 0.00 0.00 0.00 175.76 176.00 2k6z s ALA 18 N -2.07 -0.07 -0.04 0.00 0.00 -0.08 -1.66 121.76 117.84 2k6z s ALA 18 Ca -0.01 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.51 2k6z s ALA 18 Cb -0.05 0.20 -0.00 0.00 0.00 0.00 0.00 23.12 23.27 2k6z s ALA 18 CO -0.00 -0.27 -0.16 0.71 0.00 0.00 0.00 175.76 176.04 2k6z s TYR 19 N -2.18 1.62 0.17 0.00 2.02 -0.47 -1.58 117.35 116.93 2k6z s TYR 19 Ca -0.09 -0.47 -0.24 0.00 -0.37 0.00 0.00 57.07 55.90 2k6z s TYR 19 Cb -0.04 -1.10 0.06 0.00 -0.40 0.00 0.00 41.96 40.49 2k6z s TYR 19 CO -0.03 -0.17 0.96 -0.48 -1.57 0.00 0.00 175.55 174.27 2k6z s LEU 20 N 0.10 -0.14 0.05 -1.29 -0.00 -1.25 -0.86 118.68 115.29 2k6z s LEU 20 Ca -0.05 -0.48 0.05 0.00 -0.00 0.00 0.00 54.13 53.65 2k6z s LEU 20 Cb -0.12 2.18 -0.04 0.00 -0.00 0.00 0.00 46.19 48.22 2k6z s LEU 20 CO 0.02 -0.95 -0.06 -0.89 -0.00 0.00 0.00 176.35 174.47 2k6z s THR 21 N -3.10 3.65 -0.07 5.48 2.01 -1.26 -0.57 115.64 121.78 2k6z s THR 21 Ca 0.14 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.18 2k6z s THR 21 Cb -0.02 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2k6z s THR 21 CO 0.03 0.24 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.87 2k6z s LEU 22 N -1.87 2.87 0.50 4.42 2.96 0.45 -4.98 118.68 123.03 2k6z s LEU 22 Ca 0.20 -0.16 0.07 0.00 -0.22 0.00 0.00 54.13 54.03 2k6z s LEU 22 Cb -0.11 -1.60 0.02 0.00 0.50 0.00 0.00 46.19 45.00 2k6z s LEU 22 CO 0.12 0.32 0.47 -1.83 -1.32 0.00 0.00 176.35 174.12 2k6z s GLU 23 N -0.60 2.38 -0.26 1.98 4.04 -1.26 -0.13 118.70 124.86 2k6z s GLU 23 Ca 0.09 -1.74 -0.02 0.00 0.04 0.00 0.00 54.97 53.34 2k6z s GLU 23 Cb -0.11 -2.33 0.12 0.00 0.02 0.00 0.00 34.13 31.83 2k6z s GLU 23 CO 0.01 -0.49 0.28 1.21 -1.84 0.00 0.00 175.26 174.43 2k6z s ASN 24 N -4.30 1.54 0.16 0.83 3.84 -0.29 -4.90 114.94 111.82 2k6z s ASN 24 Ca 0.45 -0.54 0.27 0.00 0.21 0.00 0.00 52.86 53.25 2k6z s ASN 24 Cb -0.03 0.49 0.91 0.00 -0.55 0.00 0.00 41.25 42.07 2k6z s ASN 24 CO 0.28 -0.37 1.81 -0.81 -2.79 0.00 0.00 177.10 175.22 2k6z n PRO 25 N 5.32 0.20 -2.08 0.43 -0.04 -1.26 -1.13 135.00 136.43 2k6z n PRO 25 Ca -0.03 0.16 -0.29 0.00 -0.04 0.00 0.00 63.50 63.30 2k6z n PRO 25 Cb 0.47 -1.73 0.19 0.00 -0.04 0.00 0.00 33.50 32.39 2k6z n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k6z s GLY 26 N -3.44 1.80 0.00 0.55 0.00 -1.26 -4.72 107.32 100.25 2k6z s GLY 26 Ca 0.11 -1.43 0.17 0.00 0.00 0.00 0.00 44.72 43.58 2k6z s GLY 26 CO 0.58 -0.65 0.96 1.22 0.00 0.00 0.00 173.10 175.22 2k6z n ASP 27 N -3.65 2.05 -4.41 1.64 8.00 -1.26 -2.64 116.55 116.28 2k6z n ASP 27 Ca 0.17 -1.52 -0.22 0.00 0.71 0.00 0.00 54.79 53.93 2k6z n ASP 27 Cb 0.59 0.25 -0.10 0.00 -0.02 0.00 0.00 41.12 41.84 2k6z n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k6z s LEU 28 N -1.80 2.56 0.48 0.64 0.05 -1.26 -4.81 118.68 114.54 2k6z s LEU 28 Ca 0.17 -1.01 -0.19 0.00 0.05 0.00 0.00 54.13 53.15 2k6z s LEU 28 Cb 0.14 -0.91 -0.09 0.00 -2.05 0.00 0.00 46.19 43.28 2k6z s LEU 28 CO 0.33 -0.05 1.00 -2.16 -0.55 0.00 0.00 176.35 174.92 2k6z s PRO 29 N -3.47 3.94 0.17 1.48 0.04 -1.26 -4.17 135.00 131.73 2k6z s PRO 29 Ca 0.25 1.18 0.03 0.00 0.04 0.00 0.00 61.00 62.50 2k6z s PRO 29 Cb -0.03 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 2k6z s PRO 29 CO 0.11 -0.29 0.29 -0.51 0.04 0.00 0.00 177.00 176.64 2k6z s LEU 30 N -3.58 4.32 -0.04 -3.56 1.43 0.06 -4.98 118.68 112.33 2k6z s LEU 30 Ca 0.63 0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 53.86 2k6z s LEU 30 Cb -0.12 -2.89 0.03 0.00 0.03 0.00 0.00 46.19 43.24 2k6z s LEU 30 CO 0.21 0.03 0.05 -0.60 0.23 0.00 0.00 176.35 176.27 2k6z s ARG 31 N -3.37 -0.01 -0.30 1.70 3.52 -1.26 -0.27 118.95 118.96 2k6z s ARG 31 Ca 0.34 0.34 -0.09 0.00 -0.13 0.00 0.00 55.73 56.20 2k6z s ARG 31 Cb -0.11 -0.54 -0.01 0.00 -1.56 0.00 0.00 34.95 32.74 2k6z s ARG 31 CO 0.28 -0.32 0.13 -1.17 -0.81 0.00 0.00 175.30 173.42 2k6z s LEU 32 N 2.08 3.97 -0.02 -0.88 0.20 0.24 -1.07 118.68 123.19 2k6z s LEU 32 Ca 0.04 -0.51 0.06 0.00 0.69 0.00 0.00 54.13 54.41 2k6z s LEU 32 Cb -0.12 -1.97 -0.09 0.00 -0.43 0.00 0.00 46.19 43.58 2k6z s LEU 32 CO -0.03 -0.17 0.12 1.33 -0.29 0.00 0.00 176.35 177.30 2k6z n VAL 33 N 4.95 0.07 -3.47 1.68 0.24 0.21 -0.53 118.33 121.49 2k6z n VAL 33 Ca -0.14 -0.16 -0.05 0.00 -2.04 0.00 0.00 64.34 61.95 2k6z n VAL 33 Cb 0.49 0.14 0.02 0.00 -1.47 0.00 0.00 33.84 33.02 2k6z n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6z n GLY 34 N 2.24 1.38 3.36 7.63 0.00 -1.14 -4.69 105.19 113.97 2k6z n GLY 34 Ca -0.03 -1.15 -0.16 0.00 0.00 0.00 0.00 46.02 44.69 2k6z n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6z s ALA 35 N -1.62 1.21 0.03 4.61 0.00 -1.26 -0.85 121.76 123.88 2k6z s ALA 35 Ca 0.09 -1.73 -0.12 0.00 0.00 0.00 0.00 51.96 50.20 2k6z s ALA 35 Cb -0.03 1.32 0.01 0.00 0.00 0.00 0.00 23.12 24.43 2k6z s ALA 35 CO 0.07 -0.71 0.25 1.03 0.00 0.00 0.00 175.76 176.40 2k6z s ARG 36 N -3.48 0.71 -0.10 0.00 1.81 0.03 -4.71 118.95 113.21 2k6z s ARG 36 Ca 0.36 -0.48 -0.30 0.00 -1.72 0.00 0.00 55.73 53.59 2k6z s ARG 36 Cb 0.02 0.30 0.12 0.00 -0.45 0.00 0.00 34.95 34.94 2k6z s ARG 36 CO 0.21 -0.21 0.95 -0.08 -0.68 0.00 0.00 175.30 175.49 2k6z s THR 37 N -2.22 0.00 -0.26 0.02 -1.32 -1.26 -0.74 115.64 109.86 2k6z s THR 37 Ca -0.07 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.68 2k6z s THR 37 Cb -0.02 -1.00 0.34 0.00 -1.51 0.00 0.00 72.50 70.31 2k6z s THR 37 CO -0.02 0.00 1.80 1.55 -2.21 0.00 0.00 174.62 175.75 2k6z h PRO 38 N 2.39 0.00 -0.33 7.08 0.13 -2.00 -3.33 132.00 135.94 2k6z h PRO 38 Ca -0.20 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2k6z h PRO 38 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k6z h PRO 38 CO 0.31 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.41 2k6z n VAL 39 N -2.86 2.40 -3.75 1.56 0.24 -1.26 -4.72 118.33 109.94 2k6z n VAL 39 Ca 0.02 -1.80 -0.13 0.00 -2.04 0.00 0.00 64.34 60.40 2k6z n VAL 39 Cb 0.38 -0.26 -0.08 0.00 -1.47 0.00 0.00 33.84 32.40 2k6z n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6z s ALA 40 N -2.83 -0.81 -0.07 2.33 0.00 -1.25 -2.13 121.76 116.99 2k6z s ALA 40 Ca 0.45 0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 2k6z s ALA 40 Cb 0.36 0.11 -0.00 0.00 0.00 0.00 0.00 23.12 23.58 2k6z s ALA 40 CO 0.10 -0.28 0.02 1.49 0.00 0.00 0.00 175.76 177.08 2k6z h GLU 41 N 3.74 -0.01 -6.21 0.00 4.81 -1.15 -3.42 114.58 112.34 2k6z h GLU 41 Ca -0.30 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.44 2k6z h GLU 41 Cb 1.18 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 2k6z h GLU 41 CO 0.41 -0.01 -0.33 -0.98 -0.73 0.00 0.00 179.01 177.37 2k6z s ARG 42 N -1.46 2.50 -0.16 1.92 1.70 -1.07 -4.94 118.95 117.44 2k6z s ARG 42 Ca -0.00 -1.58 -0.12 0.00 -0.47 0.00 0.00 55.73 53.55 2k6z s ARG 42 Cb 0.00 -2.41 0.05 0.00 -0.57 0.00 0.00 34.95 32.02 2k6z s ARG 42 CO 0.00 -0.33 0.41 0.54 -1.08 0.00 0.00 175.30 174.85 2k6z s VAL 43 N -2.52 -0.01 0.08 4.99 0.11 -1.26 -2.10 120.40 119.69 2k6z s VAL 43 Ca 0.48 0.04 0.03 0.00 -2.93 0.00 0.00 61.98 59.60 2k6z s VAL 43 Cb -0.04 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.18 2k6z s VAL 43 CO 0.29 0.02 0.07 -1.61 -3.33 0.00 0.00 175.10 170.53 2k6z s GLU 44 N 0.71 2.83 -0.26 1.54 2.02 0.21 -4.73 118.70 121.02 2k6z s GLU 44 Ca -0.04 -0.71 -0.09 0.00 0.02 0.00 0.00 54.97 54.15 2k6z s GLU 44 Cb -0.05 -2.70 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 2k6z s GLU 44 CO -0.05 0.56 0.13 -1.17 0.02 0.00 0.00 175.26 174.75 2k6z s LEU 45 N -2.35 3.72 0.11 1.80 2.96 -1.26 -0.33 118.68 123.32 2k6z s LEU 45 Ca 0.28 -0.11 0.09 0.00 -0.22 0.00 0.00 54.13 54.17 2k6z s LEU 45 Cb -0.12 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 2k6z s LEU 45 CO 0.21 -0.04 -0.23 -1.00 -1.32 0.00 0.00 176.35 173.98 2k6z s HIS 46 N 1.66 1.94 0.33 5.38 3.76 -0.39 -0.49 115.29 127.48 2k6z s HIS 46 Ca 0.07 -0.41 -0.03 0.00 -0.15 0.00 0.00 55.06 54.54 2k6z s HIS 46 Cb -0.15 -1.06 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 2k6z s HIS 46 CO 0.07 0.23 0.58 -1.83 -0.85 0.00 0.00 174.74 172.94 2k6z s GLU 47 N -1.89 3.57 0.07 1.40 -1.05 0.12 -1.37 118.70 119.55 2k6z s GLU 47 Ca 0.09 -0.08 0.10 0.00 -0.15 0.00 0.00 54.97 54.92 2k6z s GLU 47 Cb -0.10 -2.62 -0.03 0.00 -0.44 0.00 0.00 34.13 30.94 2k6z s GLU 47 CO 0.05 0.14 -0.27 0.99 0.95 0.00 0.00 175.26 177.12 2k6z s THR 48 N -2.24 2.17 0.07 1.83 2.01 0.50 -2.51 115.64 117.48 2k6z s THR 48 Ca 0.43 -1.50 -0.03 0.00 0.31 0.00 0.00 61.69 60.90 2k6z s THR 48 Cb -0.10 -1.88 0.01 0.00 0.01 0.00 0.00 72.50 70.54 2k6z s THR 48 CO 0.34 0.28 0.15 2.22 -0.69 0.00 0.00 174.62 176.92 2k6z n PHE 49 N 1.51 -1.25 -4.33 4.92 -1.74 -0.26 -4.30 117.46 112.01 2k6z n PHE 49 Ca -0.17 -0.35 -0.22 0.00 -0.56 0.00 0.00 57.45 56.15 2k6z n PHE 49 Cb 0.52 0.17 -0.13 0.00 1.52 0.00 0.00 39.48 41.57 2k6z n PHE 49 CO 0.00 0.00 0.00 -1.64 -0.56 0.00 0.00 176.76 174.56 2k6z s MET 50 N -2.02 1.04 0.04 3.97 -1.94 -1.26 -0.98 119.30 118.15 2k6z s MET 50 Ca 0.03 -0.96 0.04 0.00 -1.71 0.00 0.00 55.69 53.09 2k6z s MET 50 Cb -0.01 -1.14 -0.02 0.00 2.01 0.00 0.00 34.83 35.67 2k6z s MET 50 CO 0.02 0.27 -0.12 1.03 -0.01 0.00 0.00 175.02 176.22 2k6z s ARG 51 N -1.54 0.76 0.10 2.03 0.52 0.23 -4.85 118.95 116.20 2k6z s ARG 51 Ca 0.03 -0.73 -0.21 0.00 -0.52 0.00 0.00 55.73 54.30 2k6z s ARG 51 Cb -0.09 -0.70 -0.07 0.00 0.52 0.00 0.00 34.95 34.60 2k6z s ARG 51 CO 0.03 0.17 0.64 -2.00 0.02 0.00 0.00 175.30 174.15 2k6z s GLU 52 N -1.23 4.33 -0.07 3.54 2.56 -1.26 -0.86 118.70 125.70 2k6z s GLU 52 Ca -0.02 0.88 -0.03 0.00 0.00 0.00 0.00 54.97 55.80 2k6z s GLU 52 Cb -0.08 -3.25 0.04 0.00 2.00 0.00 0.00 34.13 32.85 2k6z s GLU 52 CO 0.01 0.62 0.14 0.08 -0.56 0.00 0.00 175.26 175.55 2k6z s VAL 53 N -1.12 -0.19 -0.50 3.70 1.01 0.58 -4.87 120.40 119.01 2k6z s VAL 53 Ca 0.31 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2k6z s VAL 53 Cb -0.21 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 35.92 2k6z s VAL 53 CO 0.21 0.13 0.00 -0.62 0.00 0.00 0.00 175.10 174.83 2k6z n GLU 54 N 5.03 -1.50 -1.40 2.72 1.02 -1.26 -1.00 120.64 124.25 2k6z n GLU 54 Ca -0.10 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 2k6z n GLU 54 Cb 0.50 -4.82 0.00 0.00 -0.02 0.00 0.00 31.44 27.11 2k6z n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k6z n GLY 55 N -0.06 0.39 3.12 0.62 0.00 -1.26 -5.07 105.19 102.92 2k6z n GLY 55 Ca -0.05 -1.00 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 2k6z n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 56 N -2.81 1.45 -0.24 1.61 1.02 -0.17 -5.13 119.74 115.48 2k6z s LYS 56 Ca 0.00 -0.55 -0.12 0.00 0.02 0.00 0.00 55.97 55.32 2k6z s LYS 56 Cb 0.00 -1.33 -0.05 0.00 -0.52 0.00 0.00 37.83 35.94 2k6z s LYS 56 CO 0.00 0.27 0.24 0.15 -0.92 0.00 0.00 175.35 175.09 2k6z s LYS 57 N -0.12 4.07 -0.04 1.68 1.02 -1.26 -0.31 119.74 124.79 2k6z s LYS 57 Ca 0.01 -0.14 -0.04 0.00 0.02 0.00 0.00 55.97 55.82 2k6z s LYS 57 Cb -0.09 -3.56 0.01 0.00 -0.52 0.00 0.00 37.83 33.67 2k6z s LYS 57 CO 0.01 -0.02 0.11 0.08 -0.92 0.00 0.00 175.35 174.60 2k6z s VAL 58 N 1.30 -0.00 0.73 3.17 1.01 -0.03 -5.01 120.40 121.57 2k6z s VAL 58 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.99 2k6z s VAL 58 Cb -0.14 -0.16 0.05 0.00 0.00 0.00 0.00 36.38 36.13 2k6z s VAL 58 CO 0.07 0.00 1.08 -0.04 0.00 0.00 0.00 175.10 176.21 2k6z s MET 59 N 0.07 2.33 0.16 2.72 -1.94 -1.26 -0.60 119.30 120.78 2k6z s MET 59 Ca -0.00 0.07 -0.03 0.00 -1.71 0.00 0.00 55.69 54.02 2k6z s MET 59 Cb -0.01 -2.06 -0.03 0.00 2.01 0.00 0.00 34.83 34.74 2k6z s MET 59 CO 0.00 -1.28 0.13 0.20 -0.01 0.00 0.00 175.02 174.07 2k6z s GLY 60 N -4.48 1.02 -0.14 -0.03 0.00 -0.15 -4.76 107.32 98.78 2k6z s GLY 60 Ca 0.60 -1.42 -0.22 0.00 0.00 0.00 0.00 44.72 43.68 2k6z s GLY 60 CO 0.48 -1.26 0.55 -0.29 0.00 0.00 0.00 173.10 172.59 2k6z s MET 61 N -4.07 0.77 0.05 2.90 1.75 -1.26 -1.10 119.30 118.33 2k6z s MET 61 Ca 0.27 0.49 -0.09 0.00 -1.25 0.00 0.00 55.69 55.11 2k6z s MET 61 Cb 0.06 0.36 0.00 0.00 2.84 0.00 0.00 34.83 38.10 2k6z s MET 61 CO 0.05 -0.16 0.18 1.03 -0.65 0.00 0.00 175.02 175.47 2k6z s ARG 62 N -0.36 0.71 0.58 4.11 0.52 -1.04 -5.01 118.95 118.45 2k6z s ARG 62 Ca -0.05 -0.71 -0.16 0.00 -0.52 0.00 0.00 55.73 54.30 2k6z s ARG 62 Cb -0.03 0.29 -0.05 0.00 0.52 0.00 0.00 34.95 35.68 2k6z s ARG 62 CO 0.04 -0.20 1.04 -1.25 0.02 0.00 0.00 175.30 174.94 2k6z s PRO 63 N -2.81 3.48 0.05 3.54 0.04 -1.26 -0.70 135.00 137.34 2k6z s PRO 63 Ca -0.03 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.14 2k6z s PRO 63 Cb 0.00 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2k6z s PRO 63 CO -0.05 -0.67 -0.04 0.14 0.04 0.00 0.00 177.00 176.41 2k6z s VAL 64 N -2.53 0.33 0.03 -0.36 -7.23 0.36 -4.78 120.40 106.24 2k6z s VAL 64 Ca 0.62 -1.45 0.10 0.00 -1.81 0.00 0.00 61.98 59.44 2k6z s VAL 64 Cb -0.14 -1.03 -0.12 0.00 0.56 0.00 0.00 36.38 35.65 2k6z s VAL 64 CO 0.36 -0.73 1.34 1.55 -0.31 0.00 0.00 175.10 177.31 2k6z h PRO 65 N 3.78 0.00 -1.40 4.82 0.13 -1.94 -3.42 132.00 133.97 2k6z h PRO 65 Ca -0.34 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.10 2k6z h PRO 65 Cb 1.18 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 2k6z h PRO 65 CO 0.54 0.84 0.85 -0.59 -0.23 0.00 0.00 178.00 179.41 2k6z s PHE 66 N -2.80 -0.07 0.15 1.56 -0.12 -1.26 -4.71 117.98 110.73 2k6z s PHE 66 Ca 0.02 -0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.96 2k6z s PHE 66 Cb 0.09 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 2k6z s PHE 66 CO 0.80 -0.22 0.01 -0.51 -0.05 0.00 0.00 175.22 175.25 2k6z s LEU 67 N -2.65 3.41 0.04 -1.99 1.43 0.31 -4.98 118.68 114.24 2k6z s LEU 67 Ca 0.12 -0.30 0.04 0.00 -1.03 0.00 0.00 54.13 52.96 2k6z s LEU 67 Cb 0.03 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 2k6z s LEU 67 CO -0.04 0.11 -0.06 -0.70 0.23 0.00 0.00 176.35 175.89 2k6z s GLU 68 N -2.76 2.48 -0.02 1.70 2.56 -1.26 -0.59 118.70 120.80 2k6z s GLU 68 Ca 0.27 -0.80 -0.00 0.00 0.00 0.00 0.00 54.97 54.44 2k6z s GLU 68 Cb -0.10 -2.48 0.03 0.00 2.00 0.00 0.00 34.13 33.58 2k6z s GLU 68 CO 0.19 0.57 0.03 0.08 -0.56 0.00 0.00 175.26 175.57 2k6z s VAL 69 N -1.10 -0.05 0.68 3.70 1.01 0.63 -4.97 120.40 120.29 2k6z s VAL 69 Ca 0.20 0.19 -0.11 0.00 0.00 0.00 0.00 61.98 62.26 2k6z s VAL 69 Cb -0.11 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.19 2k6z s VAL 69 CO 0.11 0.08 1.06 -2.16 0.00 0.00 0.00 175.10 174.18 2k6z s PRO 70 N 0.96 3.04 0.49 2.72 0.04 -1.26 -0.76 135.00 140.22 2k6z s PRO 70 Ca -0.08 0.85 -0.23 0.00 0.04 0.00 0.00 61.00 61.58 2k6z s PRO 70 Cb -0.11 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 32.35 2k6z s PRO 70 CO -0.03 -1.00 1.30 -1.25 0.04 0.00 0.00 177.00 176.07 2k6z s PRO 71 N -5.10 3.52 0.00 0.56 0.04 -1.26 -3.23 135.00 129.53 2k6z s PRO 71 Ca 0.57 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2k6z s PRO 71 Cb -0.13 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 31.98 2k6z s PRO 71 CO 0.55 -0.85 0.00 1.63 0.04 0.00 0.00 177.00 178.37 2k6z n LYS 72 N -0.58 0.00 -2.37 4.56 4.76 -0.28 -4.97 118.16 119.28 2k6z n LYS 72 Ca 0.08 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.26 2k6z n LYS 72 Cb 0.45 -3.41 0.15 0.00 -1.84 0.00 0.00 35.03 30.39 2k6z n LYS 72 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k6z n GLY 73 N -2.00 -0.15 3.27 0.72 0.00 -1.20 -4.85 105.19 100.98 2k6z n GLY 73 Ca 0.00 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 2k6z n GLY 73 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k6z s ARG 74 N -5.47 0.44 -0.02 1.61 1.04 -1.26 -1.14 118.95 114.15 2k6z s ARG 74 Ca 0.71 0.54 -0.07 0.00 -1.04 0.00 0.00 55.73 55.87 2k6z s ARG 74 Cb -0.03 0.21 0.01 0.00 -2.04 0.00 0.00 34.95 33.10 2k6z s ARG 74 CO 0.48 -0.06 0.16 0.08 -0.04 0.00 0.00 175.30 175.92 2k6z s VAL 75 N 0.24 0.05 0.11 4.99 1.01 0.82 -4.98 120.40 122.65 2k6z s VAL 75 Ca -0.00 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.61 2k6z s VAL 75 Cb -0.03 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 2k6z s VAL 75 CO 0.00 -0.24 -0.20 -1.61 0.00 0.00 0.00 175.10 173.05 2k6z s GLU 76 N -0.87 1.14 -0.95 2.72 8.01 -1.26 -0.41 118.70 127.07 2k6z s GLU 76 Ca -0.10 -1.20 -0.15 0.00 0.01 0.00 0.00 54.97 53.53 2k6z s GLU 76 Cb -0.05 -1.35 -0.10 0.00 -4.31 0.00 0.00 34.13 28.32 2k6z s GLU 76 CO 0.01 0.31 2.07 1.28 0.01 0.00 0.00 175.26 178.94 2k6z n LEU 77 N 0.95 4.95 -4.70 1.80 4.32 0.26 -4.89 117.00 119.69 2k6z n LEU 77 Ca -0.18 -3.13 -0.43 0.00 -0.02 0.00 0.00 56.01 52.24 2k6z n LEU 77 Cb 0.54 -1.20 -0.03 0.00 -1.62 0.00 0.00 43.42 41.11 2k6z n LEU 77 CO 0.23 0.25 1.40 2.29 -1.22 0.00 0.00 177.39 180.35 2k6z n LYS 78 N 5.88 2.72 -0.31 3.23 2.85 -1.24 -3.93 118.16 127.36 2k6z n LYS 78 Ca 0.50 0.98 0.09 0.00 -1.05 0.00 0.00 58.31 58.83 2k6z n LYS 78 Cb 0.31 -2.84 0.30 0.00 -0.65 0.00 0.00 35.03 32.15 2k6z n LYS 78 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 2k6z h PRO 79 N 7.45 0.85 0.00 -1.58 0.13 -1.93 0.27 132.00 137.18 2k6z h PRO 79 Ca -0.45 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2k6z h PRO 79 Cb 1.22 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2k6z h PRO 79 CO 0.95 0.56 0.00 0.41 -0.23 0.00 0.00 178.00 179.69 2k6z n GLY 80 N -1.39 -0.73 0.00 1.56 0.00 -1.26 -4.12 105.19 99.25 2k6z n GLY 80 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2k6z n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 81 N 0.36 0.00 3.22 -0.02 0.00 -0.16 -4.50 105.19 104.09 2k6z n GLY 81 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 2k6z n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6z s TYR 82 N -0.31 -0.22 0.04 1.61 2.02 -0.10 -0.37 117.35 120.01 2k6z s TYR 82 Ca 0.00 0.44 -0.27 0.00 -0.37 0.00 0.00 57.07 56.87 2k6z s TYR 82 Cb 0.00 0.09 0.08 0.00 -0.40 0.00 0.00 41.96 41.73 2k6z s TYR 82 CO 0.00 -0.31 0.70 -3.38 -1.57 0.00 0.00 175.55 170.99 2k6z s HIS 83 N -0.83 -0.53 0.28 2.71 -3.43 -0.47 -3.61 115.29 109.41 2k6z s HIS 83 Ca -0.09 0.59 -0.21 0.00 -0.80 0.00 0.00 55.06 54.54 2k6z s HIS 83 Cb -0.04 0.50 -0.09 0.00 -1.43 0.00 0.00 32.58 31.52 2k6z s HIS 83 CO 0.03 -0.68 0.81 -0.06 -2.00 0.00 0.00 174.74 172.84 2k6z s PHE 84 N -2.63 3.60 -0.37 0.38 0.08 -0.62 -1.26 117.98 117.17 2k6z s PHE 84 Ca -0.02 1.51 -0.11 0.00 0.12 0.00 0.00 56.93 58.42 2k6z s PHE 84 Cb -0.01 -2.72 0.02 0.00 -0.57 0.00 0.00 43.02 39.74 2k6z s PHE 84 CO -0.04 0.23 0.21 1.41 -0.10 0.00 0.00 175.22 176.93 2k6z s MET 85 N -2.22 2.93 -0.25 0.44 1.75 0.55 -0.90 119.30 121.61 2k6z s MET 85 Ca 0.48 -1.01 -0.21 0.00 -1.25 0.00 0.00 55.69 53.70 2k6z s MET 85 Cb -0.16 -3.74 -0.02 0.00 2.84 0.00 0.00 34.83 33.75 2k6z s MET 85 CO 0.21 -0.66 0.67 -0.51 -0.65 0.00 0.00 175.02 174.08 2k6z s LEU 86 N 1.58 4.07 0.04 4.11 1.02 0.34 -0.62 118.68 129.23 2k6z s LEU 86 Ca 0.03 0.78 0.09 0.00 0.02 0.00 0.00 54.13 55.05 2k6z s LEU 86 Cb -0.19 -2.93 -0.03 0.00 0.02 0.00 0.00 46.19 43.07 2k6z s LEU 86 CO 0.07 -0.39 -0.25 -0.76 0.02 0.00 0.00 176.35 175.04 2k6z s LEU 87 N 2.54 2.17 -0.36 1.79 1.02 -0.89 -0.75 118.68 124.19 2k6z s LEU 87 Ca 0.28 -0.57 -0.02 0.00 0.02 0.00 0.00 54.13 53.84 2k6z s LEU 87 Cb -0.15 -1.21 0.00 0.00 0.02 0.00 0.00 46.19 44.84 2k6z s LEU 87 CO 0.08 0.24 0.25 0.61 0.02 0.00 0.00 176.35 177.55 2k6z n GLY 88 N 1.80 0.52 3.28 -3.19 0.00 -0.19 -1.32 105.19 106.09 2k6z n GLY 88 Ca -0.17 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 2k6z n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6z n LEU 89 N -1.49 -2.29 -0.01 0.99 4.77 -1.20 -3.15 117.00 114.63 2k6z n LEU 89 Ca -0.01 0.50 0.01 0.00 -0.03 0.00 0.00 56.01 56.49 2k6z n LEU 89 Cb 0.52 -0.99 -0.03 0.00 -2.33 0.00 0.00 43.42 40.59 2k6z n LEU 89 CO 0.15 -4.37 -0.56 0.29 -1.33 0.00 0.00 177.39 171.56 2k6z n LYS 90 N 0.71 0.77 -4.13 3.23 4.76 -0.90 -4.88 118.16 117.71 2k6z n LYS 90 Ca 0.06 -0.03 -0.15 0.00 -2.87 0.00 0.00 58.31 55.32 2k6z n LYS 90 Cb 0.51 -1.09 -0.14 0.00 -1.84 0.00 0.00 35.03 32.46 2k6z n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k6z s ARG 91 N -2.24 0.42 0.35 1.97 1.81 -1.26 -5.04 118.95 114.96 2k6z s ARG 91 Ca -0.02 -0.25 -0.26 0.00 -1.72 0.00 0.00 55.73 53.49 2k6z s ARG 91 Cb 0.02 -0.37 -0.09 0.00 -0.45 0.00 0.00 34.95 34.05 2k6z s ARG 91 CO 0.16 0.10 1.01 -1.25 -0.68 0.00 0.00 175.30 174.64 2k6z s PRO 92 N -0.29 4.40 -0.27 3.54 0.04 -1.26 -4.97 135.00 136.19 2k6z s PRO 92 Ca 0.00 1.47 -0.20 0.00 0.04 0.00 0.00 61.00 62.32 2k6z s PRO 92 Cb -0.03 -2.73 -0.02 0.00 0.04 0.00 0.00 34.50 31.76 2k6z s PRO 92 CO -0.00 0.08 0.59 -0.51 0.04 0.00 0.00 177.00 177.20 2k6z s LEU 93 N -2.24 4.08 0.30 -3.56 2.01 -0.47 -4.98 118.68 113.81 2k6z s LEU 93 Ca 0.53 0.58 0.07 0.00 0.01 0.00 0.00 54.13 55.31 2k6z s LEU 93 Cb -0.22 -2.78 -0.02 0.00 0.01 0.00 0.00 46.19 43.18 2k6z s LEU 93 CO 0.28 -0.37 0.36 -0.54 1.01 0.00 0.00 176.35 177.08 2k6z s LYS 94 N 2.47 3.06 0.15 1.70 1.02 -1.26 -4.07 119.74 122.80 2k6z s LYS 94 Ca 0.24 -1.04 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 2k6z s LYS 94 Cb -0.15 -2.71 -0.08 0.00 -0.52 0.00 0.00 37.83 34.37 2k6z s LYS 94 CO 0.09 0.20 1.26 0.00 -0.92 0.00 0.00 175.35 175.98 2k6z s ALA 95 N -2.16 3.47 0.00 5.17 0.00 -1.26 -3.31 121.76 123.68 2k6z s ALA 95 Ca 0.40 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2k6z s ALA 95 Cb -0.08 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.58 2k6z s ALA 95 CO 0.29 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2k6z n GLY 96 N 2.67 0.72 3.76 0.00 0.00 -0.50 -4.96 105.19 106.88 2k6z n GLY 96 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2k6z n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k6z s GLU 97 N -0.58 -0.63 0.03 1.61 0.41 -1.21 -4.86 118.70 113.47 2k6z s GLU 97 Ca 0.00 -0.38 -0.11 0.00 -0.41 0.00 0.00 54.97 54.08 2k6z s GLU 97 Cb 0.00 -1.69 0.01 0.00 -1.78 0.00 0.00 34.13 30.66 2k6z s GLU 97 CO 0.00 -3.27 0.22 -1.83 -0.49 0.00 0.00 175.26 169.90 2k6z s GLU 98 N -5.75 0.68 -0.02 1.61 -1.05 -1.26 -0.27 118.70 112.64 2k6z s GLU 98 Ca 0.75 -0.51 -0.04 0.00 -0.15 0.00 0.00 54.97 55.01 2k6z s GLU 98 Cb -0.05 0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.94 2k6z s GLU 98 CO 0.55 -0.20 0.09 0.08 0.95 0.00 0.00 175.26 176.73 2k6z s VAL 99 N -2.23 0.03 -0.03 1.83 1.01 0.43 -4.93 120.40 116.52 2k6z s VAL 99 Ca -0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 2k6z s VAL 99 Cb -0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 2k6z s VAL 99 CO -0.02 -0.14 0.15 -1.83 0.00 0.00 0.00 175.10 173.26 2k6z s GLU 100 N -0.43 3.36 -0.02 2.72 4.04 -1.26 -1.04 118.70 126.06 2k6z s GLU 100 Ca -0.05 -0.32 0.04 0.00 0.04 0.00 0.00 54.97 54.67 2k6z s GLU 100 Cb -0.03 -3.06 -0.01 0.00 0.02 0.00 0.00 34.13 31.05 2k6z s GLU 100 CO 0.00 0.69 -0.12 -0.51 -1.84 0.00 0.00 175.26 173.48 2k6z s LEU 101 N -1.74 1.96 -0.13 1.83 1.02 -0.44 -4.33 118.68 116.86 2k6z s LEU 101 Ca 0.24 -0.23 -0.16 0.00 0.02 0.00 0.00 54.13 54.00 2k6z s LEU 101 Cb -0.12 -0.65 -0.04 0.00 0.02 0.00 0.00 46.19 45.40 2k6z s LEU 101 CO 0.15 0.13 0.40 -1.81 0.02 0.00 0.00 176.35 175.25 2k6z s ASP 102 N -0.16 6.59 -0.00 2.29 1.01 0.08 -1.11 116.67 125.37 2k6z s ASP 102 Ca 0.02 0.70 -0.14 0.00 0.71 0.00 0.00 52.55 53.84 2k6z s ASP 102 Cb -0.06 -2.24 -0.06 0.00 1.01 0.00 0.00 42.92 41.57 2k6z s ASP 102 CO -0.00 0.05 0.39 -0.76 0.21 0.00 0.00 175.17 175.06 2k6z s LEU 103 N 0.49 4.46 -0.13 1.23 1.02 0.24 -0.79 118.68 125.20 2k6z s LEU 103 Ca 0.22 0.92 -0.01 0.00 0.02 0.00 0.00 54.13 55.28 2k6z s LEU 103 Cb -0.14 -2.59 -0.02 0.00 0.02 0.00 0.00 46.19 43.46 2k6z s LEU 103 CO 0.08 0.32 -0.09 -0.76 0.02 0.00 0.00 176.35 175.92 2k6z s LEU 104 N -1.14 2.97 0.13 1.79 1.43 -0.03 -2.14 118.68 121.69 2k6z s LEU 104 Ca 0.24 -0.21 0.07 0.00 -1.03 0.00 0.00 54.13 53.20 2k6z s LEU 104 Cb -0.16 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2k6z s LEU 104 CO 0.13 0.19 -0.17 -0.36 0.23 0.00 0.00 176.35 176.37 2k6z s PHE 105 N 0.20 1.65 0.25 0.29 0.08 -0.98 -0.62 117.98 118.85 2k6z s PHE 105 Ca -0.05 -0.48 -0.30 0.00 0.12 0.00 0.00 56.93 56.22 2k6z s PHE 105 Cb -0.15 -0.86 -0.11 0.00 -0.57 0.00 0.00 43.02 41.34 2k6z s PHE 105 CO 0.04 0.22 1.52 0.00 -0.10 0.00 0.00 175.22 176.90 2k6z s ALA 106 N -1.77 3.70 -0.48 5.36 0.00 -0.24 -3.70 121.76 124.63 2k6z s ALA 106 Ca 0.10 1.43 -0.02 0.00 0.00 0.00 0.00 51.96 53.46 2k6z s ALA 106 Cb -0.07 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2k6z s ALA 106 CO 0.05 -0.84 0.42 0.41 0.00 0.00 0.00 175.76 175.79 2k6z n GLY 107 N 2.45 0.33 1.03 0.00 0.00 -1.26 -4.54 105.19 103.19 2k6z n GLY 107 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2k6z n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 108 N -1.05 0.64 3.25 -0.02 0.00 -1.24 -5.10 105.19 101.67 2k6z n GLY 108 Ca -0.03 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 2k6z n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 109 N -3.72 1.05 -0.02 1.61 3.01 -1.25 -5.08 119.74 115.34 2k6z s LYS 109 Ca 0.00 -1.26 -0.05 0.00 -1.01 0.00 0.00 55.97 53.65 2k6z s LYS 109 Cb 0.00 -0.94 0.01 0.00 -1.01 0.00 0.00 37.83 35.88 2k6z s LYS 109 CO 0.00 0.18 0.12 0.08 0.51 0.00 0.00 175.35 176.24 2k6z s VAL 110 N -2.14 0.04 -0.18 3.17 1.01 -1.26 -2.33 120.40 118.71 2k6z s VAL 110 Ca 0.10 -0.35 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 2k6z s VAL 110 Cb -0.05 -0.29 0.07 0.00 0.00 0.00 0.00 36.38 36.11 2k6z s VAL 110 CO 0.03 -0.19 0.43 -0.22 0.00 0.00 0.00 175.10 175.15 2k6z s LEU 111 N -0.63 -0.30 -0.08 3.92 0.20 -0.91 -4.98 118.68 115.90 2k6z s LEU 111 Ca -0.07 0.96 -0.15 0.00 0.69 0.00 0.00 54.13 55.55 2k6z s LEU 111 Cb -0.04 1.41 -0.05 0.00 -0.43 0.00 0.00 46.19 47.07 2k6z s LEU 111 CO 0.01 -0.21 0.39 -0.75 -0.29 0.00 0.00 176.35 175.50 2k6z s LYS 112 N 1.77 4.11 0.14 1.98 2.20 -1.26 -0.59 119.74 128.09 2k6z s LYS 112 Ca -0.07 0.32 0.09 0.00 -0.36 0.00 0.00 55.97 55.94 2k6z s LYS 112 Cb -0.09 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 2k6z s LYS 112 CO -0.13 0.42 -0.20 0.08 -0.36 0.00 0.00 175.35 175.17 2k6z s VAL 113 N -0.19 1.83 -0.01 4.02 1.01 -0.27 -5.01 120.40 121.78 2k6z s VAL 113 Ca 0.22 -1.79 0.04 0.00 0.00 0.00 0.00 61.98 60.46 2k6z s VAL 113 Cb -0.15 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 2k6z s VAL 113 CO 0.10 -0.20 -0.14 -0.69 0.00 0.00 0.00 175.10 174.16 2k6z s VAL 114 N -1.69 1.15 -0.12 2.92 1.01 -1.26 -1.33 120.40 121.08 2k6z s VAL 114 Ca 0.13 -0.62 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 2k6z s VAL 114 Cb -0.07 -0.96 0.04 0.00 0.00 0.00 0.00 36.38 35.39 2k6z s VAL 114 CO 0.06 0.33 0.39 -1.48 0.00 0.00 0.00 175.10 174.40 2k6z s LEU 115 N -0.32 0.50 1.06 3.92 2.34 -0.21 -4.76 118.68 121.21 2k6z s LEU 115 Ca 0.05 0.67 -0.13 0.00 0.06 0.00 0.00 54.13 54.78 2k6z s LEU 115 Cb -0.06 1.40 0.22 0.00 -0.56 0.00 0.00 46.19 47.19 2k6z s LEU 115 CO -0.00 -0.21 1.08 -2.16 -1.06 0.00 0.00 176.35 173.99 2k6z s PRO 116 N -0.13 -0.09 0.06 1.48 0.04 -1.26 -0.43 135.00 134.67 2k6z s PRO 116 Ca -0.03 0.52 0.09 0.00 0.04 0.00 0.00 61.00 61.62 2k6z s PRO 116 Cb -0.03 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.80 2k6z s PRO 116 CO 0.02 -3.09 -0.23 0.08 0.04 0.00 0.00 177.00 173.82 2k6z s VAL 117 N -2.85 2.44 -0.02 -0.36 1.01 0.63 -0.61 120.40 120.64 2k6z s VAL 117 Ca 0.66 -1.37 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 2k6z s VAL 117 Cb -0.20 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2k6z s VAL 117 CO 0.59 0.30 0.11 -1.61 0.00 0.00 0.00 175.10 174.49 2k6z s GLU 118 N -1.48 0.29 -0.92 2.72 0.41 -0.33 -1.41 118.70 117.98 2k6z s GLU 118 Ca 0.13 -0.13 -0.03 0.00 -0.41 0.00 0.00 54.97 54.54 2k6z s GLU 118 Cb -0.10 0.12 0.23 0.00 -1.78 0.00 0.00 34.13 32.60 2k6z s GLU 118 CO 0.04 -0.06 2.20 0.00 -0.49 0.00 0.00 175.26 176.96 2k6z n ALA 119 N 2.28 6.44 -1.24 5.21 0.00 -1.26 -3.66 120.51 128.28 2k6z n ALA 119 Ca -0.17 -4.04 0.00 0.00 0.00 0.00 0.00 53.44 49.23 2k6z n ALA 119 Cb 0.57 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.78 2k6z n ALA 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37